2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(diphenylmethyl)propanamide

Systemtic Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(diphenylmethyl)propanamide Openeye Name: N-benzhydryl-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(diphenylmethyl)propanamide IUPAC Name: N-benzhydryl-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-benzhydryl-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C25H30N4OS MolecularWeight: 434.5969

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CCCCC2)SC(C)C(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN=C(N1C2CCCCC2)SC(C)C(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H30N4OS/c1-18(31-25-28-27-19(2)29(25)22-16-10-5-11-17-22)24(30)26-23(20-12-6-3-7-13-20)21-14-8-4-9-15-21/h3-4,6-9,12-15,18,22-23H,5,10-11,16-17H2,1-2H3,(H,26,30)